BDBM83347 MLS000734011::N-[[1-(2,5-dimethylphenyl)-3-phenyl-4-pyrazolyl]methyl]-1-(1,2,4-triazol-1-yl)-2-propanamine::N-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]-1-(1,2,4-triazol-1-yl)propan-2-amine::N-[[1-(2,5-dimethylphenyl)-3-phenylpyrazol-4-yl]methyl]-1-(1,2,4-triazol-1-yl)propan-2-amine::N-{[1-(2,5-dimethylphenyl)-3-phenyl-1H-pyrazol-4-yl]methyl}-1-(1H-1,2,4-triazol-1-yl)propan-2-amine::SMR000316647::[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-[1-methyl-2-(1,2,4-triazol-1-yl)ethyl]amine::cid_16190428

SMILES Cc1ccc2c(c1)[nH]c1c(=O)n(CCC(=O)N3CCN(c4ccc(Cl)cc4Cl)CC3)cnc12

InChI Key InChIKey=MEMKNMSANHWTDT-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 83347   

TargetThiamine pyrophosphokinase 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 83347BDBM83347(3-(3-(4-(2,4-dichlorophenyl)piperazin-1-yl)-3-oxop...)
Affinity DataEC50:  1.78E+3nMAssay Description:Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2026
Entry Details
US Patent